Geometry & MOs

Info

ID:	360174
PubChem CID:	127300790
Reduced:	ON4C22H28 (1)
Stoich.:	AB4C22D28 (1)
Weight, g/mol:	389.221561
ΔH_f, kcal/mol:	5.21
Dipole, Da:	6.29
IP(EA), eV:	-9.02(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dimethylquinolin-3-yl)-[4-[methyl-(6-methylpyridazin-3-yl)amino]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)NC4=NN=CC=C4

DOS

IR

Vibrations